4-(5-butylthiophen-2-yl)-6-(3-methylphenyl)-2-oxidanylidene-1H-pyridine-3-carbonitrile

Systemtic Name: 4-(5-butylthiophen-2-yl)-6-(3-methylphenyl)-2-oxidanylidene-1H-pyridine-3-carbonitrile Openeye Name: 4-(5-butyl-2-thienyl)-6-(m-tolyl)-2-oxo-1H-pyridine-3-carbonitrile CAS Name: 4-(5-butyl-2-thiophenyl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carbonitrile IUPAC Name: 4-(5-butylthiophen-2-yl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carbonitrile Traditional Name: 4-(5-butyl-2-thienyl)-2-keto-6-(m-tolyl)-1H-pyridine-3-carbonitrile Formula: C21H20N2OS MolecularWeight: 348.4613

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(S1)C2=C(C(=O)NC(=C2)C3=CC(=CC=C3)C)C#N

Isomeric SMILES

CCCCC1=CC=C(S1)C2=C(C(=O)NC(=C2)C3=CC(=CC=C3)C)C#N

InChI

InChI=1S/C21H20N2OS/c1-3-4-8-16-9-10-20(25-16)17-12-19(23-21(24)18(17)13-22)15-7-5-6-14(2)11-15/h5-7,9-12H,3-4,8H2,1-2H3,(H,23,24)